[1,1′-Biphenyl]-4-carboxylic acid, (3aR,4R,5R,6aS)-hexahydro-2-oxo-4-[(1E)-3-oxo-1-octen-1-yl]-2H-cyclopenta[b]furan-5-yl ester

CAS Registry Number®

31753-00-1
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CAS Name

[1,1′-Biphenyl]-4-carboxylic acid, (3aR,4R,5R,6aS)-hexahydro-2-oxo-4-[(1E)-3-oxo-1-octen-1-yl]-2H-cyclopenta[b]furan-5-yl ester

Molecular Formula

C28H30O5

Molecular Mass

446.53

Cite this Page

[1,1′-Biphenyl]-4-carboxylic acid, (3aR,4R,5R,6aS)-hexahydro-2-oxo-4-[(1E)-3-oxo-1-octen-1-yl]-2H-cyclopenta[b]furan-5-yl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=31753-00-1 (retrieved 2024-09-07) (CAS RN: 31753-00-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C28H30O5/c1-2-3-5-10-22(29)15-16-23-24-17-27(30)32-26(24)18-25(23)33-28(31)21-13-11-20(12-14-21)19-8-6-4-7-9-19/h4,6-9,11-16,23-26H,2-3,5,10,17-18H2,1H3/b16-15+/t23-,24-,25-,26+/m1/s1

InChIKey

InChIKey=KVAPQSSLLZXBHI-LMXHIZBGSA-N

SMILES

C(=C/C(CCCCC)=O)\[C@@H]1[C@@]2([C@](C[C@H]1OC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)(OC(=O)C2)[H])[H]

Canonical SMILES

O=C(OC1CC2OC(=O)CC2C1C=CC(=O)CCCCC)C=3C=CC(=CC3)C=4C=CC=CC4

Other Names for this Substance

  • [1,1′-Biphenyl]-4-carboxylic acid, (3aR,4R,5R,6aS)-hexahydro-2-oxo-4-[(1E)-3-oxo-1-octen-1-yl]-2H-cyclopenta[b]furan-5-yl ester
  • [1,1′-Biphenyl]-4-carboxylic acid, hexahydro-2-oxo-4-(3-oxo-1-octenyl)-2H-cyclopenta[b]furan-5-yl ester, [3aα,4α(E),5β,6aα]-(-)-
  • 4-Biphenylcarboxylic acid, ester with 3,3aα,4,5,6,6aα-hexahydro-5β-hydroxy-6α-(3-oxo-1-octenyl)-2H-cyclopenta[b]furan-2-one, (E)-(-)-
  • [1,1′-Biphenyl]-4-carboxylic acid, (3aR,4R,5R,6aS)-hexahydro-2-oxo-4-[(1E)-3-oxo-1-octenyl]-2H-cyclopenta[b]furan-5-yl ester
  • 2H-Cyclopenta[b]furan, [1,1′-biphenyl]-4-carboxylic acid deriv.